In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 31 | Yes |
Popular Name: N-[3-[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]propyl]pyridine-4-carboxamide N-[3-[1-[2-(azepan-1-yl)-2-oxo-e…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.35 | 10.32 | -22.8 | 1 | 7 | 0 | 80 | 419.529 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 10.75 | -44.06 | 2 | 7 | 1 | 81 | 420.537 | 7 | ↓ |